3-Cyclohexen-1-ol, 1-(1,5-dimethyl-4-hexenyl)-4-methyl-
- Formula: C15H26O
- Molecular weight: 222.3663
- IUPAC Standard InChI: InChI=1S/C15H26O/c1-12(2)6-5-7-14(4)15(16)10-8-13(3)9-11-15/h6,8,14,16H,5,7,9-11H2,1-4H3/t14-,15+/m0/s1
- IUPAC Standard InChIKey: WTVHAMTYZJGJLJ-LSDHHAIUSA-N
- CAS Registry Number: 15352-77-9
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Stereoisomers:
- Other names: β-Bisabolol
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Normal alkane RI, polar column, temperature ramp
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
| Column type | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|
| Active phase | TC-Wax | Innowax FSC | DB-Wax | DB-Wax |
| Column length (m) | 60. | 60. | 27. | 60. |
| Carrier gas | He | Helium | He | He |
| Substrate | ||||
| Column diameter (mm) | 0.25 | 0.25 | 0.53 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.20 | 0.25 | |
| Tstart (C) | 60. | 60. | 120. | 60. |
| Tend (C) | 240. | 220. | 220. | 240. |
| Heat rate (K/min) | 2. | 4. | 4. | 4. |
| Initial hold (min) | 10. | |||
| Final hold (min) | ||||
| I | 2143. | 2170. | 2160. | 2151. |
| Reference | Miyazawa and Tamura, 2007 | Lourens, Reddy, et al., 2004 | Braun, Meier, et al., 2003 | Ngassoum, Yonkeu, et al., 1999 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Miyazawa and Tamura, 2007
Miyazawa, M.; Tamura, N.,
Components of the essential oil from sprouts of Polygonum hydropiper L. ('Benitade'),
Flavour Fragr. J., 2007, 22, 3, 188-190, https://doi.org/10.1002/ffj.1779
. [all data]
Lourens, Reddy, et al., 2004
Lourens, A.C.U.; Reddy, D.; Baser, K.H.C.; Viljoen, A.M.; Van Vuuren, S.F.,
In vitro Biological Activity and Essential Oil Composition of Four Indigenous South Africal Helichrysum Species,
J. Ethnopharmacol., 2004, 95, 2-3, 253-258, https://doi.org/10.1016/j.jep.2004.07.027
. [all data]
Braun, Meier, et al., 2003
Braun, N.A.; Meier, M.; Schmaus, G.; Hölscher, B.; Pickenhagen, W.,
Enantioselectivity in odor perception: synthesis and olfactory properties of iso-β-bisabolol, a new natural product,
Helv. Chim. Acta, 2003, 86, 7, 2698-2708, https://doi.org/10.1002/hlca.200390219
. [all data]
Ngassoum, Yonkeu, et al., 1999
Ngassoum, M.B.; Yonkeu, S.; Jirovetz, L.; Buchbauer, G.; Schmaus, G.; Hammerschmidt, F.-J.H.,
Chemical composition of essential oils of Lantana camara leaves and flowers from Cameroon and Madagascar,
Flavour Fragr. J., 1999, 14, 4, 245-250, https://doi.org/10.1002/(SICI)1099-1026(199907/08)14:4<245::AID-FFJ819>3.0.CO;2-X
. [all data]
Notes
Go To: Top, Normal alkane RI, polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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